Thus, following some basic rules, and with a good balance, it is by the internal reference, Sigma-Aldrich certified its

a-Aldrich certified its TraceCERT CRMs

possible to routinely perform qNMR measurements with 0.5 - 1% under optimal conditions, so that their uncertainties down to 0.1%
measurement uncertainty. In order to minimize the increments would not dominate the overall result.3

Standards for 1H quantitative NMR, TraceCERT®

D2O CDCl3 DMSO-d6 CD3OD CD3CN
δ δ δ δ δ
PN Substance (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml)
01380 Ethylene carbonate 4.5 5.5 >250 4.5 7.0 >250 4.5 2.7 >250 4.5 5.3 >250 4.5 2.0 >250
03826 Calcium formate 8.4 3.4 >250 - - - - - - - - - - - -
8.1 3.7 8.0 3.3 8.0 4.3 8.0 4.5
06185 Benzoic acid - - - 7.7 4.0 150 7.6 3.7 >250 7.6 4.4 >250 7.7 2.5 80
7.5 3.4 7.5 3.0 7.5 3.9 7.5 2.6
06856 Duroquinone - - - 2.0 3.3 >250 2.0 3.1 30 2.0 4.0 10 2.0 5.4 20
Dimethyl 8.1 3.6 8.1 2.9 8.1 4.4 8.1 4.9
07038 - - - 160 20 4.0 20
terephthalate 4.0 1.8 3.9 1.1 4.0 2.4 3.9 2.6
Potassium hydrogen
14659 7.5 2.5 >250* - - - - - - 7.9 2.5 5.0 - - -
phthalate
1,2,4,5-Tetrachloro-
40384 - - - 7.8 10.7 >250 8.5 12.6 >250 9.4 9.6 50 6.8 6.4 10
3-nitro-benzene
41867 Dimethyl sulfone 3.0 2.9 >250 3.0 2.7 80 3.0 2.4 >250 3.0 3.3 40 2.9 2.6 >250
7.9 3.8 7.8 2.5 7.9 3.4 7.9 5.6
Ethyl 4 6.7 2.4 6.7 1.4 6.7 2.5 6.7 3.7
42582 (dimethyl-amino) - - - 4.3 2.8 >250 4.2 1.9 >250 4.3 3.3 >250 4.3 4.1 50
benzoate 3.1 2.0 3.0 1.5 3.0 2.2 3.0 3.6
1.4 2.5 1.3 2.1 1.4 2.7 1.3 3.6
7.1 3.8 7.0 2.0 7.0 3.7 7.1 4.9
6.8 4.5 6.7 2.2 6.6 4.4 6.7 5.7
6.6 4.8 6.5 2.6 6.5 5.8 6.6 5.7
50409 Thymol - - - >250 >250 >250 >250
3.2 4.3 3.1 2.3 3.2 4.0 3.2 5.2
2.3 3.1 2.2 2.0 2.2 2.8 2.2 3.5
1.3 1.9 1.1 0.9 1.2 1.8 1.2 2.4
5.4 4.3 5.4 2.2 5.4 2.0 5.4 1.0
55177 Benzyl benzoate - - - >250 >250 >250 >250
8.1 13.6 8.0 8.8 8.1 3.9 8.1 2.4
1,3,5-Trimethoxy- 6.1 4.7 6.1 3.2 6.1 4.8 6.7 3.4
74599 - - - >250 >250 >250 >250
benzene 3.8 2.2 3.7 1.4 3.8 2.7 4.3 2.6
1,2,4,5- 7.0 6.1 6.9 4.7 6.9 5.9 6.9 7.7
74658 - - - >250 10 10 50
Tetramethyl-benzene 2.2 4.0 2.1 2.6 2.2 4.3 2.2 5.0
89151 Dimethylmalonic acid 1.3 1.0 100 - - - 1.3 0.7 250 1.4 1.0 250 1.4 2.0 30
92816 Maleic acid 6.3 6.1 >250 - - - 6.3 3.0 >250 6.3 3.9 10 6.4 2.3 20
9.3 8.0 9.1 9.4 9.1 9.0
Methyl 3,5-
94681 - - - 9.2 6.1 >250 8.9 7.6 100 - - - 9.0 8.2 >250
dinitrobenzoate
4.1 2.6 4.0 1.5 4.0 3.5

Standards for 31P quantitative NMR, TraceCERT®

D2O CDCl3 DMSO-d6 CD3OD CD3CN
δ δ δ δ δ
PN Substance (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml)
05498 Triphenyl phosphate - - - -17.7 2.7 >250 -17.3 1.2 >100 -17.5 3.1 >10 -17 4.3 >250
Potassium phosphate
92214 0.08 8.0 >250 - - - - - - - - - - - -
monobasic
96708 Phosphonoacetic acid 15.7 4.6 >250 - - - 14.9 1.5 >250 17.7 2.9 >250 - - -

Standards for 19F quantitative NMR, TraceCERT®

D2O CDCl3 DMSO-d6 CD3OD CD3CN
δ δ δ δ δ
PN Substance (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml) (ppm) T1 (s) s (mg/ml)
4,4’-Difluoro-
07563 - - - -105.8 2.4 >250 -106.5 1.4 150 -108.1 2.8 30 -108.3 2.3 140
benzophenone
2,4-Dichloro-
53396 - - - -62.5 2.3 >250 -61.2 1.2 >250 -65.4 3.3 >250 -63 2.9 >250
benzotrifluoride
2-Chloro-4-
80730 - - - -115.8 4.4 >250 -115.3 3.3 >250 -117.7 4.8 >250 -117.3 4.7 >250
fluorotoluene

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